N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide

C23H25N5O2 — CID 53194371

IUPACN-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide
SMILESCC(C)Cn1c(=O)c2cc(C(=O)N(C)CCc3ccccn3)nn2c2ccccc21
InChIInChI=1S/C23H25N5O2/c1-16(2)15-27-19-9-4-5-10-20(19)28-21(23(27)30)14-18(25-28)22(29)26(3)13-11-17-8-6-7-12-24-17/h4-10,12,14,16H,11,13,15H2,1-3H3
InChIKeyQBLPJIHLYWUEMB-UHFFFAOYSA-N
MW403.49 g/mol
LogP3.01
Rot. Bonds6

About N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide

N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide (PubChem CID 53194371) has the molecular formula C23H25N5O2 and a molecular weight of 403.49 g/mol. Its IUPAC name is N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide
PubChem CID53194371
Molecular FormulaC23H25N5O2
Molecular Weight403.49 g/mol
Exact Mass403.20
IUPAC NameN-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide
SMILESCC(C)Cn1c(=O)c2cc(C(=O)N(C)CCc3ccccn3)nn2c2ccccc21
InChIInChI=1S/C23H25N5O2/c1-16(2)15-27-19-9-4-5-10-20(19)28-21(23(27)30)14-18(25-28)22(29)26(3)13-11-17-8-6-7-12-24-17/h4-10,12,14,16H,11,13,15H2,1-3H3
InChIKeyQBLPJIHLYWUEMB-UHFFFAOYSA-N
XLogP3.01
TPSA72.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.49
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,5-bis(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
CID 53194389
N-(2-methoxyethyl)-5-(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carboxamide
CID 53194364
1-(2-aminoethyl)-N-methyl-N-(2-pyridin-2-ylethyl)imidazole-4-carboxamide
CID 107495803
1-(2-fluorophenyl)-N-methyl-N-(2-pyridin-2-ylethyl)pyrazole-3-carboxamide
CID 60589600
N-methyl-3-(2-oxo-3-propylbenzimidazol-1-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 134008720
methyl 3-[[5-(2-methylpropyl)-4-oxopyrazolo[1,5-a]quinoxaline-2-carbonyl]amino]benzoate
CID 53194377
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158
4-bromo-N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrrole-2-carboxamide
CID 43411200
4-hydroxy-1-(2-methylpropyl)-2-oxo-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide
CID 54695771
2-amino-3-hydroxy-N-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 115180171
2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoacetic acid
CID 43445021
N-methyl-N-(2-pyridin-2-ylethyl)-3-sulfanylbenzamide
CID 107021824

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide?
The IUPAC name of N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide (CID 53194371) is N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide.
What is the SMILES notation for N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide?
The canonical SMILES for N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide is CC(C)Cn1c(=O)c2cc(C(=O)N(C)CCc3ccccn3)nn2c2ccccc21.
What is the InChIKey of N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide?
The InChIKey is QBLPJIHLYWUEMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N5O2/c1-16(2)15-27-19-9-4-5-10-20(19)28-21(23(27)30)14-18(25-28)22(29)26(3)13-11-17-8-6-7-12-24-17/h4-10,12,14,16H,11,13,15H2,1-3H3.
What are the key properties of N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide?
N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide has a molecular weight of 403.49 g/mol, XLogP of 3.01, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(2-methylpropyl)-4-oxo-N-(2-pyridin-2-ylethyl)pyrazolo[1,5-a]quinoxaline-2-carboxamide is sourced from PubChem (CID 53194371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).